7-(3,3-dimethyl-2-oxobutyl)-1-[(furan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(3,3-dimethyl-2-oxobutyl)-1-[(furan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
7-(3,3-dimethyl-2-oxobutyl)-1-[(furan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V029-7557 |
| Compound Name: | 7-(3,3-dimethyl-2-oxobutyl)-1-[(furan-2-yl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)C(Cn1cnc2c1C(N(Cc1ccco1)C(N2c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5555 |
| logD: | 2.5555 |
| logSw: | -2.5399 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.542 |
| InChI Key: | WGVYEYZZVXBYPV-UHFFFAOYSA-N |